Geometry & MOs

Info

ID:	122015
PubChem CID:	50789627
Reduced:	FO2N4H23C25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	392.140593
ΔH_f, kcal/mol:	-62.16
Dipole, Da:	8.1
IP(EA), eV:	-8.84(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-8-methylsulfonyl-2-oxo-N-(2-phenylethyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(N3)CCC4=CC=C(C=C4)NC(=O)C)F

DOS

IR

Vibrations